1-(3-chlorophenyl)-4-(2,6-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3-chlorophenyl)-4-(2,6-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3-chlorophenyl)-4-(2,6-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1720 |
| Compound Name: | 1-(3-chlorophenyl)-4-(2,6-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 425.87 |
| Molecular Formula: | C22 H20 Cl N3 O4 |
| Smiles: | Cc1c2C(CC(Nc2n(c2cccc(c2)[Cl])n1)=O)C(c1c(cccc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5919 |
| logD: | 2.587 |
| logSw: | -3.718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.091 |
| InChI Key: | LPEJLPTUCZIDNU-HNNXBMFYSA-N |